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• 8da2bea08b XTB main lingyu zeng 2025-03-23 22:29:47 +08:00
• ca31731955 一次性添加 mm644706215 2025-03-15 11:08:51 +08:00
• a00c4a384a resp orca docker-compose file bak mm644706215 2025-01-17 15:29:19 +08:00
• 0409e0e203 remove mm644706215 2025-01-17 15:28:43 +08:00
• 648a52c931 only 3dqsar build mm644706215 2025-01-17 15:28:15 +08:00
• 6382cb20f1 add software record mm644706215 2025-01-17 15:22:48 +08:00
• ee0e0f2ee1 Multiwfn可以计算的分子描述符一览 mm644706215 2025-01-17 00:36:33 +08:00
• f8dd8a94c7 old version (no orca) mm644706215 2025-01-17 00:12:41 +08:00
• d444199990 update to orca mm644706215 2025-01-17 00:07:30 +08:00
• 989b014997 add engine mm644706215 2025-01-17 00:06:25 +08:00
• a323e52ee5 Initial commit lingyu zeng 2024-09-25 21:57:48 +08:00